SCHEMBL20400797

SCHEMBL20400797

O=C(O)c1ccc(NCc2ccc(C3CCCCC3)cc2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.50
PPM1D O15297 3/20 0.46
HAO1 Q9UJM8 1/20 0.46
KMO O15229 1/20 0.46
SERPINE1 P05121 1/20 0.46
STAT3 P40763 3/20 0.45
SSTR3 P32745 1/20 0.44
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
VNN1 O95497 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20400984 0.86 S1PR1 (0.49) KDM4CPPM1DHAO1KMOSERPINE1
SCHEMBL20401001 0.86 SERPINE1 (0.51) KDM4CPPM1DHAO1KMOSERPINE1
SCHEMBL20401410 0.85 STAT3 (0.46) KDM4CHAO1KMOSTAT3SSTR3
SCHEMBL20401023 0.84 ALOX15 (0.53) KDM4CPPM1DSTAT3MEN1ALDH1A1
SCHEMBL2647028 0.80 HAO1 (0.52) KDM4CHAO1KMOSERPINE1MEN1
SCHEMBL1711030 0.79 HDAC8 (0.59) KDM4CMEN1ALDH1A1POLBKMT2A
SCHEMBL20401097 0.78 PTGFR (0.53) KDM4CMEN1ALDH1A1POLBKMT2A
SCHEMBL11511834 0.77 USP1 (0.48) KDM4CKMT2AHTR2CHTR2BHDAC1
SCHEMBL20401012 0.76 S1PR1 (0.46) KDM4CHAO1KMOSTAT3MEN1
SCHEMBL32660010 0.75 ALOX15 (0.61) PPM1DSSTR3ALDH1A1POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018136935-A1 2-ARYLSULFONAMIDO-N-ARYLACETAMIDE DERIVATIZED STAT3 INHIBITORS UNIVERSITY OF HAWAII (US) 2018-07-26 WO disclosed